9-Bromomethylacridine

C₁₄H₁₀BrNCAS 1556-34-9272.14 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₄H₁₀BrN
Molar mass: 272.14 g/mol
Exact mass: 270.9997 Da
logP: 4.28Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation97.5% of notifiers

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

1556-34-9

SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)CBr

InChIKey

MZFYKBHQWLWIBI-UHFFFAOYSA-N

InChI

InChI=1S/C14H10BrN/c15-9-12-10-5-1-3-7-13(10)16-14-8-4-2-6-11(12)14/h1-8H,9H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

9-(Bromomethyl)acridine

Work with 9-Bromomethylacridine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,7-Bis(9-acridinyl)heptane141946-28-359 % similar 9-Chloroacridine1207-69-848 % similar 9-Methylacridine611-64-348 % similar 9-Phenylacridine602-56-246 % similar Phenazine92-82-045 % similar 3-(Bromomethyl)-2-cyclopropyl-4-(4-fluorophenyl)quinoline154057-56-445 % similar 2-(Bromomethyl)quinoline5632-15-545 % similar 2-(Bromomethyl)-1,3-benzothiazole106086-78-644 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4'-(Bromomethyl)-2-cyanobiphenyl114772-54-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook